4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide

Systemtic Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide Openeye Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide CAS Name: 4-[(3,5-dimethyl-1-pyrazolyl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide IUPAC Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide Traditional Name: 4-[(3,5-dimethylpyrazol-1-yl)methyl]-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide Formula: C16H18N6O MolecularWeight: 310.35372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NCC3=NC=NN3)C

Isomeric SMILES

CC1=CC(=NN1CC2=CC=C(C=C2)C(=O)NCC3=NC=NN3)C

InChI

InChI=1S/C16H18N6O/c1-11-7-12(2)22(21-11)9-13-3-5-14(6-4-13)16(23)17-8-15-18-10-19-20-15/h3-7,10H,8-9H2,1-2H3,(H,17,23)(H,18,19,20)